| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 47.4 | Very low | 73.8 | Confident | 238 Ų | 238 | 91.4 Ų | 91.4 | 100% | 1.172 | 44% | 0.441 | S | S | * | . | 0 | 102.8 | 0 | -65.4 | 179.2 | 174.4 | 0 | 0 | 106.7 | S3 | M1-S3 PolarHBondContact O-N 2.71Š| |||
| 2 | A | 53.4 | Low | 74.8 | Confident | 42 Ų | 42 | 90.3 Ų | 90.3 | 35% | 0.347 | 44% | 0.436 | S | S | . | . | trans | -70.9 | 116.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 107.4 | I29 | A2-I29 HydrophobicContact CB-CG2 3.49Å; A2-I29 VanDerWaalsContact CB-CG2 3.49Å | ||
| 3 | S | 66.3 | Low | 75.8 | Confident | 69 Ų | 69 | 87.8 Ų | 87.8 | 48% | 0.483 | 43% | 0.426 | S | S | . | . | trans | -58 | 144.1 | 176.2 | 15.6 | 0 | 0 | 0 | 0 | 109.9 | M1 E5 R6 | M1-S3 PolarHBondContact O-N 2.71Å; S3-E5 PolarHBondContact O-N 3.49Å; S3-R6 VanDerWaalsContact O-CB 3.31Å; S3-R6 WeakPolarHBondContact O-CB 3.32Å; S3-R6 PolarHBondContact O-N 3.12Å | ||
| 4 | N | 67.9 | Low | 76.4 | Confident | 77 Ų | 77 | 86.2 Ų | 86.2 | 41% | 0.412 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -51.7 | -29.2 | 178.6 | -70.8 | -57.4 | 0 | 0 | 0 | 113.3 | R6 L7 Y8 V55 | N4-R6 VanDerWaalsContact C-N 3.28Å; N4-R6 PolarHBondContact O-N 3.25Å; N4-L7 PolarHBondContact O-N 3.46Å; N4-Y8 PolarHBondContact O-N 2.93Å; N4-V55 HydrophobicContact CB-CG1 4.15Å; N4-V55 VanDerWaalsContact CG-CG1 3.49Å |
| 5 | E | 76.8 | Confident | 76.8 | Confident | 144 Ų | 144 | 84.9 Ų | 84.9 | 67% | 0.673 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -56.5 | -40.4 | 172.8 | -62.3 | 172.3 | 135.3 | 0 | 0 | 112.4 | S3 L7 Y8 E9 | S3-E5 PolarHBondContact O-N 3.49Å; E5-L7 VanDerWaalsContact C-N 3.34Å; E5-L7 PolarHBondContact O-N 3.05Å; E5-Y8 PolarHBondContact O-N 3.46Å; E5-E9 WeakPolarHBondContact O-CG 3.41Å; E5-E9 PolarHBondContact O-N 2.87Å |
| 6 | R | 82.8 | Confident | 77.4 | Confident | 115 Ų | 115 | 86.7 Ų | 86.7 | 43% | 0.434 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -67.4 | -37.8 | -179.3 | -173.4 | 58.7 | 177.4 | 175.2 | -0.9 | 112 | S3 N4 Y8 E9 V10 I29 | S3-R6 VanDerWaalsContact O-CB 3.31Å; S3-R6 WeakPolarHBondContact O-CB 3.32Å; S3-R6 PolarHBondContact O-N 3.12Å; N4-R6 VanDerWaalsContact C-N 3.28Å; N4-R6 PolarHBondContact O-N 3.25Å; R6-Y8 VanDerWaalsContact C-N 3.31Å; R6-E9 WeakPolarHBondContact CD-OE2 3.34Å; R6-E9 IonicContact CZ-OE2 3.86Å; R6-E9 IonicContact NH1-OE2 2.86Å; R6-E9 PolarHBondContact NH1-OE2 3.26Å; R6-E9 PolarHBondContact O-N 2.92Å; R6-V10 HydrophobicContact CG-CG2 4.48Å; R6-V10 VanDerWaalsContact O-CG2 3.25Å; R6-V10 WeakPolarHBondContact O-CG2 3.4Å; R6-V10 PolarHBondContact O-N 2.92Å; R6-I29 HydrophobicContact CG-CD1 3.92Å |
| 7 | L | 80.2 | Confident | 78 | Confident | 13 Ų | 13 | 89.2 Ų | 89.2 | 7% | 0.068 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -64.1 | -41.3 | 177.2 | -163.6 | 146.3 | 0 | 0 | 0 | 110.4 | N4 E5 W11 W26 I29 F30 Y34 L59 | N4-L7 PolarHBondContact O-N 3.46Å; E5-L7 VanDerWaalsContact C-N 3.34Å; E5-L7 PolarHBondContact O-N 3.05Å; L7-W11 WeakPolarHBondContact O-CB 3.43Å; L7-W11 PolarHBondContact O-N 3.32Å; L7-W26 HydrophobicContact CD2-CZ2 3.97Å; L7-W26 PolarHBondContact O-NE1 3.3Å; L7-I29 HydrophobicContact CB-CG2 4.3Å; L7-I29 HydrophobicContact CD1-CG2 4.18Å; L7-I29 HydrophobicContact CG-CG2 4.5Å; L7-F30 HydrophobicContact CD1-CB 3.94Å; L7-F30 HydrophobicContact CD1-CD2 3.98Å; L7-F30 HydrophobicContact CD1-CG 4.46Å; L7-Y34 HydrophobicContact CD1-CE2 4.26Å; L7-L59 HydrophobicContact CD2-CD1 3.96Å |
| 8 | Y | 80.9 | Confident | 78.2 | Confident | 143 Ų | 143 | 95.9 Ų | 95.9 | 56% | 0.561 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -67.6 | -43.9 | 175.1 | -174.4 | -103.6 | 0 | 0 | 0 | 113.1 | N4 E5 R6 V10 W11 M12 | N4-Y8 PolarHBondContact O-N 2.93Å; E5-Y8 PolarHBondContact O-N 3.46Å; R6-Y8 VanDerWaalsContact C-N 3.31Å; Y8-V10 VanDerWaalsContact C-N 3.34Å; Y8-V10 PolarHBondContact O-N 3.48Å; Y8-W11 WeakPolarHBondContact O-CB 3.43Å; Y8-W11 PolarHBondContact O-N 3.35Å; Y8-M12 HydrophobicContact CD1-CE 3.56Å; Y8-M12 HydrophobicContact CD1-CG 4.22Å; Y8-M12 HydrophobicContact CD1-SD 3.98Å; Y8-M12 HydrophobicContact CE1-CE 3.37Å; Y8-M12 HydrophobicContact CE1-CG 3.81Å; Y8-M12 HydrophobicContact CE1-SD 3.23Å; Y8-M12 WeakPolarHBondContact CE1-SD 3.27Å; Y8-M12 HydrophobicContact CE2-CG 4.39Å; Y8-M12 WeakPolarHBondContact O-CG 3.45Å; Y8-M12 PolarHBondContact O-N 2.87Å |
| 9 | E | 86.6 | Confident | 78.5 | Confident | 88 Ų | 88 | 93.9 Ų | 93.9 | 41% | 0.411 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -55.4 | -49 | 175.2 | -77.2 | 176.4 | -179.1 | 0 | 0 | 112.1 | E5 R6 W11 M12 L13 | E5-E9 WeakPolarHBondContact O-CG 3.41Å; E5-E9 PolarHBondContact O-N 2.87Å; R6-E9 WeakPolarHBondContact CD-OE2 3.34Å; R6-E9 IonicContact CZ-OE2 3.86Å; R6-E9 IonicContact NH1-OE2 2.86Å; R6-E9 PolarHBondContact NH1-OE2 3.26Å; R6-E9 PolarHBondContact O-N 2.92Å; E9-W11 VanDerWaalsContact C-N 3.33Å; E9-M12 PolarHBondContact O-N 3.27Å; E9-L13 WeakPolarHBondContact O-CG 3.42Å; E9-L13 PolarHBondContact O-N 3.24Å |
| 10 | V | 86.6 | Confident | 78.6 | Confident | 2 Ų | 2 | 93.9 Ų | 93.9 | 1% | 0.012 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -68.9 | -35.7 | -178.3 | -177.6 | 0 | 0 | 0 | 0 | 110.6 | R6 Y8 L13 Y14 Y22 I25 W26 I29 | R6-V10 HydrophobicContact CG-CG2 4.48Å; R6-V10 VanDerWaalsContact O-CG2 3.25Å; R6-V10 WeakPolarHBondContact O-CG2 3.4Å; R6-V10 PolarHBondContact O-N 2.92Å; Y8-V10 VanDerWaalsContact C-N 3.34Å; Y8-V10 PolarHBondContact O-N 3.48Å; V10-L13 PolarHBondContact O-N 3.33Å; V10-Y14 PolarHBondContact O-N 2.87Å; V10-Y22 HydrophobicContact CG1-CD1 4.5Å; V10-Y22 WeakPolarHBondContact CG1-O 3.18Å; V10-I25 HydrophobicContact CG1-CB 4.11Å; V10-I25 HydrophobicContact CG1-CG2 4Å; V10-I25 HydrophobicContact CG2-CG2 4.15Å; V10-W26 HydrophobicContact CB-CB 4.41Å; V10-W26 HydrophobicContact CG1-CB 3.8Å; V10-I29 HydrophobicContact CG2-CD1 4.2Å |
| 11 | W | 83.4 | Confident | 79 | Confident | 74 Ų | 74 | 94.3 Ų | 94.3 | 28% | 0.28 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61 | -47.4 | 172.2 | -176.4 | -106.8 | 0 | 0 | 0 | 112.1 | L7 Y8 E9 L13 Y14 C15 F23 W26 | L7-W11 WeakPolarHBondContact O-CB 3.43Å; L7-W11 PolarHBondContact O-N 3.32Å; Y8-W11 WeakPolarHBondContact O-CB 3.43Å; Y8-W11 PolarHBondContact O-N 3.35Å; E9-W11 VanDerWaalsContact C-N 3.33Å; W11-L13 VanDerWaalsContact C-N 3.31Å; W11-L13 PolarHBondContact O-N 3.48Å; W11-Y14 HydrophobicContact CE3-CD1 4.24Å; W11-Y14 HydrophobicContact CH2-CD1 4.39Å; W11-Y14 HydrophobicContact CH2-CE1 4.43Å; W11-Y14 HydrophobicContact CZ3-CD1 4.04Å; W11-Y14 HydrophobicContact CZ3-CE1 4.35Å; W11-Y14 WeakPolarHBondContact O-CB 3.2Å; W11-Y14 PolarHBondContact O-N 3.5Å; W11-Y14 VanDerWaalsContact O-N 3.17Å; W11-C15 PolarHBondContact O-N 2.91Å; W11-C15 PolarHBondContact O-SG 3.21Å; W11-C15 VanDerWaalsContact O-SG 3.36Å; W11-F23 HydrophobicContact CZ3-CD2 4.38Å; W11-F23 HydrophobicContact CZ3-CE2 4.34Å; W11-W26 HydrophobicContact CE3-CD2 4.07Å; W11-W26 AromaticContact CE3-CE2 3.81Å; W11-W26 HydrophobicContact CE3-CG 4.29Å; W11-W26 HydrophobicContact CE3-CZ2 4.23Å; W11-W26 AromaticContact CE3-NE1 3.83Å |
| 12 | M | 84.9 | Confident | 80.8 | Confident | 78 Ų | 78 | 85.7 Ų | 85.7 | 38% | 0.384 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.6 | -39.5 | 175.7 | -73.1 | -166.1 | -63.2 | 0 | 0 | 112.2 | Y8 E9 Y14 C15 T16 | Y8-M12 HydrophobicContact CD1-CE 3.56Å; Y8-M12 HydrophobicContact CD1-CG 4.22Å; Y8-M12 HydrophobicContact CD1-SD 3.98Å; Y8-M12 HydrophobicContact CE1-CE 3.37Å; Y8-M12 HydrophobicContact CE1-CG 3.81Å; Y8-M12 HydrophobicContact CE1-SD 3.23Å; Y8-M12 WeakPolarHBondContact CE1-SD 3.27Å; Y8-M12 HydrophobicContact CE2-CG 4.39Å; Y8-M12 WeakPolarHBondContact O-CG 3.45Å; Y8-M12 PolarHBondContact O-N 2.87Å; E9-M12 PolarHBondContact O-N 3.27Å; M12-Y14 VanDerWaalsContact C-N 3.33Å; M12-C15 PolarHBondContact O-N 3.41Å; M12-T16 VanDerWaalsContact O-CB 3.3Å; M12-T16 WeakPolarHBondContact O-CB 3.47Å; M12-T16 PolarHBondContact O-N 2.96Å; M12-T16 PolarHBondContact O-OG1 3.5Å |
| 13 | L | 87.6 | Confident | 82.2 | Confident | 58 Ų | 58 | 85.2 Ų | 85.2 | 30% | 0.304 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -62.3 | -41.5 | 174.7 | -74.9 | 169.8 | 0 | 0 | 0 | 111.4 | E9 V10 W11 T16 K17 Y22 | E9-L13 WeakPolarHBondContact O-CG 3.42Å; E9-L13 PolarHBondContact O-N 3.24Å; V10-L13 PolarHBondContact O-N 3.33Å; W11-L13 VanDerWaalsContact C-N 3.31Å; W11-L13 PolarHBondContact O-N 3.48Å; L13-T16 PolarHBondContact O-N 3.47Å; L13-K17 WeakPolarHBondContact O-CB 3.28Å; L13-K17 PolarHBondContact O-N 3.47Å; L13-Y22 HydrophobicContact CB-CD1 3.95Å; L13-Y22 HydrophobicContact CB-CD2 4.1Å; L13-Y22 HydrophobicContact CB-CE1 4.22Å; L13-Y22 HydrophobicContact CB-CE2 4.41Å; L13-Y22 HydrophobicContact CB-CG 3.91Å; L13-Y22 HydrophobicContact CD1-CD1 4.12Å; L13-Y22 HydrophobicContact CD1-CE1 3.93Å |
| 14 | Y | 84.5 | Confident | 83.1 | Confident | 66 Ų | 66 | 87.7 Ų | 87.7 | 26% | 0.259 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -61.4 | -49.3 | 171.9 | 171.8 | -111.7 | 0 | 0 | 0 | 111.6 | V10 W11 M12 T16 R18 D19 F23 | V10-Y14 PolarHBondContact O-N 2.87Å; W11-Y14 HydrophobicContact CE3-CD1 4.24Å; W11-Y14 HydrophobicContact CH2-CD1 4.39Å; W11-Y14 HydrophobicContact CH2-CE1 4.43Å; W11-Y14 HydrophobicContact CZ3-CD1 4.04Å; W11-Y14 HydrophobicContact CZ3-CE1 4.35Å; W11-Y14 WeakPolarHBondContact O-CB 3.2Å; W11-Y14 PolarHBondContact O-N 3.5Å; W11-Y14 VanDerWaalsContact O-N 3.17Å; M12-Y14 VanDerWaalsContact C-N 3.33Å; Y14-T16 VanDerWaalsContact C-N 3.26Å; Y14-T16 PolarHBondContact O-N 3.26Å; Y14-R18 WeakPolarHBondContact O-CA 3.48Å; Y14-R18 PolarHBondContact O-N 3.31Å; Y14-D19 WeakPolarHBondContact CD2-O 3.36Å; Y14-F23 HydrophobicContact CD1-CD2 4.43Å; Y14-F23 HydrophobicContact CD2-CB 3.67Å; Y14-F23 HydrophobicContact CE1-CD2 4.36Å; Y14-F23 HydrophobicContact CE2-CB 3.81Å; Y14-F23 HydrophobicContact CE2-CG 4.38Å; Y14-F23 HydrophobicContact CG-CB 4.14Å |
| 15 | C | 82 | Confident | 84.1 | Confident | 66 Ų | 66 | 87.2 Ų | 87.2 | 45% | 0.446 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60 | -37.4 | 178.2 | -66 | 0 | 0 | 0 | 0 | 112.7 | W11 M12 | W11-C15 PolarHBondContact O-N 2.91Å; W11-C15 PolarHBondContact O-SG 3.21Å; W11-C15 VanDerWaalsContact O-SG 3.36Å; M12-C15 PolarHBondContact O-N 3.41Å |
| 16 | T | 87.3 | Confident | 84.5 | Confident | 114 Ų | 114 | 80.4 Ų | 80.4 | 70% | 0.699 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -77.8 | -46.5 | -176.9 | -55.4 | 0 | 0 | 0 | 0 | 112.1 | M12 L13 Y14 | M12-T16 VanDerWaalsContact O-CB 3.3Å; M12-T16 WeakPolarHBondContact O-CB 3.47Å; M12-T16 PolarHBondContact O-N 2.96Å; M12-T16 PolarHBondContact O-OG1 3.5Å; L13-T16 PolarHBondContact O-N 3.47Å; Y14-T16 VanDerWaalsContact C-N 3.26Å; Y14-T16 PolarHBondContact O-N 3.26Å |
| 17 | K | 87.3 | Confident | 84.5 | Confident | 129 Ų | 129 | 76.5 Ų | 76.5 | 56% | 0.561 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -97.3 | -16.6 | -173.1 | -60 | -147.1 | -174.7 | 171.2 | 0 | 113.9 | L13 D19 Y22 | L13-K17 WeakPolarHBondContact O-CB 3.28Å; L13-K17 PolarHBondContact O-N 3.47Å; K17-D19 HydrophobicContact CB-CB 4.28Å; K17-D19 PolarHBondContact O-N 2.86Å; K17-D19 VanDerWaalsContact O-N 3.12Å; K17-Y22 HydrophobicContact CB-CD2 4.3Å; K17-Y22 HydrophobicContact CB-CE2 4.03Å; K17-Y22 HydrophobicContact CD-CE2 3.87Å; K17-Y22 HydrophobicContact CG-CE2 4.23Å |
| 18 | R | 80.9 | Confident | 84.7 | Confident | 211 Ų | 211 | 81.3 Ų | 81.3 | 80% | 0.796 | 39% | 0.387 | S | S | * | . | trans | 51.6 | 28.4 | -174.2 | -61.1 | -176.4 | 177.1 | -174.8 | -2.3 | 113.4 | Y14 | Y14-R18 WeakPolarHBondContact O-CA 3.48Å; Y14-R18 PolarHBondContact O-N 3.31Å | ||
| 19 | D | 84 | Confident | 84.8 | Confident | 57 Ų | 57 | 75.7 Ų | 75.7 | 31% | 0.305 | 37% | 0.366 | S | S | . | . | trans | -88.9 | 121.8 | -178.1 | -175.6 | -23.6 | 0 | 0 | 0 | 109.4 | Y14 K17 D21 Y22 | Y14-D19 WeakPolarHBondContact CD2-O 3.36Å; K17-D19 HydrophobicContact CB-CB 4.28Å; K17-D19 PolarHBondContact O-N 2.86Å; K17-D19 VanDerWaalsContact O-N 3.12Å; D19-D21 PolarHBondContact O-N 2.87Å; D19-D21 WeakPolarHBondContact OD1-CB 3.37Å; D19-D21 PolarHBondContact OD1-N 2.96Å; D19-Y22 HydrophobicContact CB-CD2 3.7Å; D19-Y22 HydrophobicContact CB-CE2 3.95Å; D19-Y22 PolarHBondContact O-N 3.4Å | ||
| 20 | P | 80.4 | Confident | 84.5 | Confident | 93 Ų | 93 | 71.6 Ų | 71.6 | 60% | 0.604 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -61.3 | -21.4 | -179.5 | 26.5 | -35.5 | 0 | 0 | 0 | 113.6 | Y22 F23 K24 | P20-Y22 VanDerWaalsContact C-N 3.35Å; P20-F23 WeakPolarHBondContact O-CB 3.24Å; P20-F23 PolarHBondContact O-N 3.33Å; P20-K24 PolarHBondContact O-N 2.85Å |
| 21 | D | 87.3 | Confident | 84.1 | Confident | 104 Ų | 104 | 74.8 Ų | 74.8 | 56% | 0.556 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -65.9 | -37.9 | 176.4 | -74.9 | -35.4 | 0 | 0 | 0 | 111.5 | D19 F23 K24 I25 | D19-D21 PolarHBondContact O-N 2.87Å; D19-D21 WeakPolarHBondContact OD1-CB 3.37Å; D19-D21 PolarHBondContact OD1-N 2.96Å; D21-F23 VanDerWaalsContact C-N 3.32Å; D21-F23 PolarHBondContact O-N 3.47Å; D21-K24 PolarHBondContact O-N 3.36Å; D21-I25 WeakPolarHBondContact O-CD1 3.35Å; D21-I25 VanDerWaalsContact O-CG1 3.26Å; D21-I25 WeakPolarHBondContact O-CG1 3.3Å; D21-I25 PolarHBondContact O-N 3.41Å |
| 22 | Y | 86.3 | Confident | 83.8 | Confident | 57 Ų | 57 | 74.8 Ų | 74.8 | 22% | 0.224 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -66.7 | -37.5 | 172.8 | -65.8 | -59.1 | 0 | 0 | 0 | 111.4 | V10 L13 K17 D19 P20 K24 I25 W26 | V10-Y22 HydrophobicContact CG1-CD1 4.5Å; V10-Y22 WeakPolarHBondContact CG1-O 3.18Å; L13-Y22 HydrophobicContact CB-CD1 3.95Å; L13-Y22 HydrophobicContact CB-CD2 4.1Å; L13-Y22 HydrophobicContact CB-CE1 4.22Å; L13-Y22 HydrophobicContact CB-CE2 4.41Å; L13-Y22 HydrophobicContact CB-CG 3.91Å; L13-Y22 HydrophobicContact CD1-CD1 4.12Å; L13-Y22 HydrophobicContact CD1-CE1 3.93Å; K17-Y22 HydrophobicContact CB-CD2 4.3Å; K17-Y22 HydrophobicContact CB-CE2 4.03Å; K17-Y22 HydrophobicContact CD-CE2 3.87Å; K17-Y22 HydrophobicContact CG-CE2 4.23Å; D19-Y22 HydrophobicContact CB-CD2 3.7Å; D19-Y22 HydrophobicContact CB-CE2 3.95Å; D19-Y22 PolarHBondContact O-N 3.4Å; P20-Y22 VanDerWaalsContact C-N 3.35Å; Y22-K24 VanDerWaalsContact C-N 3.32Å; Y22-K24 PolarHBondContact O-N 2.87Å; Y22-I25 PolarHBondContact O-N 3.31Å; Y22-W26 VanDerWaalsContact O-CB 3.3Å; Y22-W26 WeakPolarHBondContact O-CB 3.38Å; Y22-W26 PolarHBondContact O-N 2.83Å |
| 23 | F | 83.2 | Confident | 83.3 | Confident | 31 Ų | 31 | 73.3 Ų | 73.3 | 14% | 0.136 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -64.5 | -38.7 | 176.2 | -177.9 | -110.7 | 0 | 0 | 0 | 112 | W11 Y14 P20 D21 W26 L27 L67 | W11-F23 HydrophobicContact CZ3-CD2 4.38Å; W11-F23 HydrophobicContact CZ3-CE2 4.34Å; Y14-F23 HydrophobicContact CD1-CD2 4.43Å; Y14-F23 HydrophobicContact CD2-CB 3.67Å; Y14-F23 HydrophobicContact CE1-CD2 4.36Å; Y14-F23 HydrophobicContact CE2-CB 3.81Å; Y14-F23 HydrophobicContact CE2-CG 4.38Å; Y14-F23 HydrophobicContact CG-CB 4.14Å; P20-F23 WeakPolarHBondContact O-CB 3.24Å; P20-F23 PolarHBondContact O-N 3.33Å; D21-F23 VanDerWaalsContact C-N 3.32Å; D21-F23 PolarHBondContact O-N 3.47Å; F23-W26 HydrophobicContact CD2-CE3 4.43Å; F23-W26 HydrophobicContact CE2-CE3 4.01Å; F23-W26 HydrophobicContact CE2-CZ3 4.3Å; F23-W26 WeakPolarHBondContact O-CB 3.49Å; F23-W26 PolarHBondContact O-N 2.94Å; F23-L27 HydrophobicContact CD1-CD1 4Å; F23-L27 HydrophobicContact CE1-CD1 3.34Å; F23-L27 HydrophobicContact CE1-CG 4.09Å; F23-L27 HydrophobicContact CE2-CD1 4.42Å; F23-L27 HydrophobicContact CE2-CG 4.31Å; F23-L27 HydrophobicContact CZ-CD1 3.54Å; F23-L27 HydrophobicContact CZ-CD2 4.41Å; F23-L27 HydrophobicContact CZ-CG 3.83Å; F23-L27 WeakPolarHBondContact O-CB 3.42Å; F23-L27 PolarHBondContact O-N 2.88Å; F23-L67 HydrophobicContact CE1-CD2 4.24Å; F23-L67 HydrophobicContact CE2-CD1 4.07Å; F23-L67 HydrophobicContact CE2-CD2 3.68Å; F23-L67 HydrophobicContact CE2-CG 4.49Å; F23-L67 HydrophobicContact CZ-CD1 3.74Å; F23-L67 HydrophobicContact CZ-CD2 3.22Å; F23-L67 HydrophobicContact CZ-CG 4Å |
| 24 | K | 84.4 | Confident | 82.6 | Confident | 121 Ų | 121 | 71.3 Ų | 71.3 | 53% | 0.526 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.1 | -46.8 | 173.7 | -172.7 | -178.9 | 177 | -174.4 | 0 | 112 | P20 D21 Y22 W26 L27 E28 | P20-K24 PolarHBondContact O-N 2.85Å; D21-K24 PolarHBondContact O-N 3.36Å; Y22-K24 VanDerWaalsContact C-N 3.32Å; Y22-K24 PolarHBondContact O-N 2.87Å; K24-W26 VanDerWaalsContact C-N 3.3Å; K24-W26 PolarHBondContact O-N 3.44Å; K24-L27 WeakPolarHBondContact O-CB 3.45Å; K24-L27 PolarHBondContact O-N 2.92Å; K24-E28 WeakPolarHBondContact CE-OE1 3.42Å; K24-E28 WeakPolarHBondContact O-CG 3.19Å; K24-E28 PolarHBondContact O-N 3.28Å |
| 25 | I | 88.1 | Confident | 81.8 | Confident | 68 Ų | 68 | 74.3 Ų | 74.3 | 35% | 0.349 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.6 | -42 | 176.5 | -66.7 | 164 | 0 | 0 | 0 | 110.5 | V10 D21 Y22 L27 E28 I29 | V10-I25 HydrophobicContact CG1-CB 4.11Å; V10-I25 HydrophobicContact CG1-CG2 4Å; V10-I25 HydrophobicContact CG2-CG2 4.15Å; D21-I25 WeakPolarHBondContact O-CD1 3.35Å; D21-I25 VanDerWaalsContact O-CG1 3.26Å; D21-I25 WeakPolarHBondContact O-CG1 3.3Å; D21-I25 PolarHBondContact O-N 3.41Å; Y22-I25 PolarHBondContact O-N 3.31Å; I25-L27 VanDerWaalsContact C-N 3.33Å; I25-L27 PolarHBondContact O-N 2.96Å; I25-E28 PolarHBondContact O-N 2.87Å; I25-I29 HydrophobicContact CG2-CD1 3.7Å; I25-I29 HydrophobicContact CG2-CG1 4.44Å; I25-I29 WeakPolarHBondContact O-CB 3.46Å; I25-I29 WeakPolarHBondContact O-CD1 3.4Å; I25-I29 WeakPolarHBondContact O-CG1 3.32Å; I25-I29 PolarHBondContact O-N 2.92Å |
| 26 | W | 86.8 | Confident | 81 | Confident | 0 Ų | 0 | 80.2 Ų | 80.2 | 0% | 0 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -59.4 | -45.4 | 176.1 | -178.4 | 89.8 | 0 | 0 | 0 | 111.4 | L7 V10 W11 Y22 F23 K24 I29 F30 L59 I63 L67 | L7-W26 HydrophobicContact CD2-CZ2 3.97Å; L7-W26 PolarHBondContact O-NE1 3.3Å; V10-W26 HydrophobicContact CB-CB 4.41Å; V10-W26 HydrophobicContact CG1-CB 3.8Å; W11-W26 HydrophobicContact CE3-CD2 4.07Å; W11-W26 AromaticContact CE3-CE2 3.81Å; W11-W26 HydrophobicContact CE3-CG 4.29Å; W11-W26 HydrophobicContact CE3-CZ2 4.23Å; W11-W26 AromaticContact CE3-NE1 3.83Å; Y22-W26 VanDerWaalsContact O-CB 3.3Å; Y22-W26 WeakPolarHBondContact O-CB 3.38Å; Y22-W26 PolarHBondContact O-N 2.83Å; F23-W26 HydrophobicContact CD2-CE3 4.43Å; F23-W26 HydrophobicContact CE2-CE3 4.01Å; F23-W26 HydrophobicContact CE2-CZ3 4.3Å; F23-W26 WeakPolarHBondContact O-CB 3.49Å; F23-W26 PolarHBondContact O-N 2.94Å; K24-W26 VanDerWaalsContact C-N 3.3Å; K24-W26 PolarHBondContact O-N 3.44Å; W26-I29 PolarHBondContact O-N 2.74Å; W26-F30 HydrophobicContact CE3-CB 4.42Å; W26-F30 HydrophobicContact CH2-CB 4.45Å; W26-F30 AromaticContact CH2-CD2 3.98Å; W26-F30 HydrophobicContact CH2-CD2 3.98Å; W26-F30 HydrophobicContact CH2-CE2 4.48Å; W26-F30 HydrophobicContact CH2-CG 4.14Å; W26-F30 HydrophobicContact CZ2-CD2 4.15Å; W26-F30 HydrophobicContact CZ3-CB 4.31Å; W26-F30 HydrophobicContact CZ3-CG 4.31Å; W26-F30 VanDerWaalsContact O-CB 3.25Å; W26-F30 WeakPolarHBondContact O-CB 3.48Å; W26-F30 PolarHBondContact O-N 2.9Å; W26-L59 HydrophobicContact CH2-CD1 4.2Å; W26-L59 HydrophobicContact CZ2-CD1 3.63Å; W26-L59 HydrophobicContact CZ2-CD2 3.96Å; W26-L59 HydrophobicContact CZ2-CG 4.47Å; W26-I63 HydrophobicContact CH2-CG1 4.14Å; W26-L67 HydrophobicContact CH2-CD1 4.38Å; W26-L67 HydrophobicContact CZ3-CD1 3.76Å |
| 27 | L | 81.9 | Confident | 79.8 | Confident | 34 Ų | 34 | 78.7 Ų | 78.7 | 18% | 0.178 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 176.9 | -90.2 | 172.6 | 0 | 0 | 0 | 112.4 | F23 K24 I25 I29 F30 I31 L67 | F23-L27 HydrophobicContact CD1-CD1 4Å; F23-L27 HydrophobicContact CE1-CD1 3.34Å; F23-L27 HydrophobicContact CE1-CG 4.09Å; F23-L27 HydrophobicContact CE2-CD1 4.42Å; F23-L27 HydrophobicContact CE2-CG 4.31Å; F23-L27 HydrophobicContact CZ-CD1 3.54Å; F23-L27 HydrophobicContact CZ-CD2 4.41Å; F23-L27 HydrophobicContact CZ-CG 3.83Å; F23-L27 WeakPolarHBondContact O-CB 3.42Å; F23-L27 PolarHBondContact O-N 2.88Å; K24-L27 WeakPolarHBondContact O-CB 3.45Å; K24-L27 PolarHBondContact O-N 2.92Å; I25-L27 VanDerWaalsContact C-N 3.33Å; I25-L27 PolarHBondContact O-N 2.96Å; L27-I29 VanDerWaalsContact C-N 3.31Å; L27-I29 PolarHBondContact O-N 3.2Å; L27-F30 PolarHBondContact O-N 2.9Å; L27-I31 WeakPolarHBondContact O-CB 3.12Å; L27-I31 VanDerWaalsContact O-CG1 3.25Å; L27-I31 WeakPolarHBondContact O-CG1 3.35Å; L27-I31 PolarHBondContact O-N 3.4Å; L27-L67 HydrophobicContact CD2-CD1 3.96Å |
| 28 | E | 84.7 | Confident | 78.8 | Confident | 113 Ų | 113 | 73.7 Ų | 73.7 | 53% | 0.528 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -60.2 | -43.7 | 177.6 | -74.5 | 175.5 | -175.9 | 0 | 0 | 111.3 | K24 I25 S32 | K24-E28 WeakPolarHBondContact CE-OE1 3.42Å; K24-E28 WeakPolarHBondContact O-CG 3.19Å; K24-E28 PolarHBondContact O-N 3.28Å; I25-E28 PolarHBondContact O-N 2.87Å; E28-S32 WeakPolarHBondContact O-CB 3.29Å; E28-S32 PolarHBondContact O-N 3.41Å |
| 29 | I | 83.1 | Confident | 78.1 | Confident | 25 Ų | 25 | 66.3 Ų | 66.3 | 13% | 0.128 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -66.6 | -43.5 | 176.8 | -66.2 | 168.2 | 0 | 0 | 0 | 110.9 | A2 R6 L7 V10 I25 W26 L27 S32 S33 | A2-I29 HydrophobicContact CB-CG2 3.49Å; A2-I29 VanDerWaalsContact CB-CG2 3.49Å; R6-I29 HydrophobicContact CG-CD1 3.92Å; L7-I29 HydrophobicContact CB-CG2 4.3Å; L7-I29 HydrophobicContact CD1-CG2 4.18Å; L7-I29 HydrophobicContact CG-CG2 4.5Å; V10-I29 HydrophobicContact CG2-CD1 4.2Å; I25-I29 HydrophobicContact CG2-CD1 3.7Å; I25-I29 HydrophobicContact CG2-CG1 4.44Å; I25-I29 WeakPolarHBondContact O-CB 3.46Å; I25-I29 WeakPolarHBondContact O-CD1 3.4Å; I25-I29 WeakPolarHBondContact O-CG1 3.32Å; I25-I29 PolarHBondContact O-N 2.92Å; W26-I29 PolarHBondContact O-N 2.74Å; L27-I29 VanDerWaalsContact C-N 3.31Å; L27-I29 PolarHBondContact O-N 3.2Å; I29-S32 PolarHBondContact O-N 3.12Å; I29-S33 VanDerWaalsContact O-CB 3.27Å; I29-S33 WeakPolarHBondContact O-CB 3.39Å; I29-S33 PolarHBondContact O-N 2.92Å; I29-S33 PolarHBondContact O-OG 3.2Å; I29-S33 VanDerWaalsContact O-OG 3.12Å |
| 30 | F | 80.1 | Confident | 77 | Confident | 2 Ų | 2 | 67.4 Ų | 67.4 | 1% | 0.009 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -61.5 | -51.2 | 178.1 | -179.7 | -92.5 | 0 | 0 | 0 | 111 | L7 W26 L27 S32 S33 Y34 L38 L56 L59 I63 L64 | L7-F30 HydrophobicContact CD1-CB 3.94Å; L7-F30 HydrophobicContact CD1-CD2 3.98Å; L7-F30 HydrophobicContact CD1-CG 4.46Å; W26-F30 HydrophobicContact CE3-CB 4.42Å; W26-F30 HydrophobicContact CH2-CB 4.45Å; W26-F30 AromaticContact CH2-CD2 3.98Å; W26-F30 HydrophobicContact CH2-CD2 3.98Å; W26-F30 HydrophobicContact CH2-CE2 4.48Å; W26-F30 HydrophobicContact CH2-CG 4.14Å; W26-F30 HydrophobicContact CZ2-CD2 4.15Å; W26-F30 HydrophobicContact CZ3-CB 4.31Å; W26-F30 HydrophobicContact CZ3-CG 4.31Å; W26-F30 VanDerWaalsContact O-CB 3.25Å; W26-F30 WeakPolarHBondContact O-CB 3.48Å; W26-F30 PolarHBondContact O-N 2.9Å; L27-F30 PolarHBondContact O-N 2.9Å; F30-S32 VanDerWaalsContact C-N 3.35Å; F30-S32 PolarHBondContact O-N 3.19Å; F30-S33 PolarHBondContact O-N 3.18Å; F30-Y34 HydrophobicContact CD1-CD2 4.44Å; F30-Y34 AromaticContact CD2-CD2 3.6Å; F30-Y34 HydrophobicContact CD2-CD2 3.6Å; F30-Y34 AromaticContact CD2-CE2 3.58Å; F30-Y34 HydrophobicContact CD2-CE2 3.58Å; F30-Y34 HydrophobicContact CE1-CD2 4.42Å; F30-Y34 AromaticContact CE2-CD2 3.57Å; F30-Y34 HydrophobicContact CE2-CD2 3.57Å; F30-Y34 AromaticContact CE2-CE2 3.58Å; F30-Y34 HydrophobicContact CE2-CE2 3.58Å; F30-Y34 HydrophobicContact CG-CD2 4.04Å; F30-Y34 HydrophobicContact CG-CE2 4.4Å; F30-Y34 HydrophobicContact CZ-CD2 4.01Å; F30-Y34 HydrophobicContact CZ-CE2 4.42Å; F30-Y34 WeakPolarHBondContact O-CD2 3.41Å; F30-Y34 PolarHBondContact O-N 3.14Å; F30-L38 HydrophobicContact CD1-CD1 3.83Å; F30-L38 HydrophobicContact CE1-CD1 3.45Å; F30-L38 VanDerWaalsContact CE1-CD1 3.45Å; F30-L38 HydrophobicContact CE1-CD2 4.09Å; F30-L38 HydrophobicContact CE1-CG 4.36Å; F30-L38 HydrophobicContact CZ-CD1 4.28Å; F30-L38 HydrophobicContact CZ-CD2 4.29Å; F30-L56 HydrophobicContact CE2-CD2 3.88Å; F30-L56 HydrophobicContact CZ-CD2 4.12Å; F30-L59 HydrophobicContact CD2-CD1 3.83Å; F30-L59 HydrophobicContact CE2-CD1 3.59Å; F30-I63 HydrophobicContact CZ-CG2 4.36Å; F30-L64 HydrophobicContact CD1-CD2 4.2Å; F30-L64 HydrophobicContact CE1-CD1 3.99Å; F30-L64 HydrophobicContact CE1-CD2 3.61Å; F30-L64 HydrophobicContact CE1-CG 3.8Å; F30-L64 HydrophobicContact CZ-CD2 4.5Å; F30-L64 HydrophobicContact CZ-CG 4.3Å |
| 31 | I | 77.3 | Confident | 76.2 | Confident | 70 Ų | 70 | 68.8 Ų | 68.8 | 36% | 0.359 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.2 | -44.7 | 179.8 | -66.5 | 164.7 | 0 | 0 | 0 | 110.5 | L27 Y34 E35 | L27-I31 WeakPolarHBondContact O-CB 3.12Å; L27-I31 VanDerWaalsContact O-CG1 3.25Å; L27-I31 WeakPolarHBondContact O-CG1 3.35Å; L27-I31 PolarHBondContact O-N 3.4Å; I31-Y34 CarbonylContact O-C 3.52Å; I31-Y34 PolarHBondContact O-N 2.93Å; I31-E35 VanDerWaalsContact O-CA 3.24Å; I31-E35 WeakPolarHBondContact O-CA 3.47Å; I31-E35 WeakPolarHBondContact O-CB 3.3Å; I31-E35 PolarHBondContact O-N 3.23Å |
| 32 | S | 78.3 | Confident | 75 | Confident | 73 Ų | 73 | 68 Ų | 68 | 51% | 0.51 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -67.3 | -37.1 | 178.5 | -177.4 | 0 | 0 | 0 | 0 | 113 | E28 I29 F30 Y34 | E28-S32 WeakPolarHBondContact O-CB 3.29Å; E28-S32 PolarHBondContact O-N 3.41Å; I29-S32 PolarHBondContact O-N 3.12Å; F30-S32 VanDerWaalsContact C-N 3.35Å; F30-S32 PolarHBondContact O-N 3.19Å; S32-Y34 VanDerWaalsContact C-N 3.3Å; S32-Y34 PolarHBondContact O-N 3.31Å |
| 33 | S | 74.4 | Confident | 73.7 | Confident | 48 Ų | 48 | 73.1 Ų | 73.1 | 34% | 0.336 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -71.3 | -26.9 | 178.8 | -74.1 | 0 | 0 | 0 | 0 | 113 | I29 F30 | I29-S33 VanDerWaalsContact O-CB 3.27Å; I29-S33 WeakPolarHBondContact O-CB 3.39Å; I29-S33 PolarHBondContact O-N 2.92Å; I29-S33 PolarHBondContact O-OG 3.2Å; I29-S33 VanDerWaalsContact O-OG 3.12Å; F30-S33 PolarHBondContact O-N 3.18Å |
| 34 | Y | 71.6 | Confident | 72.5 | Confident | 15 Ų | 15 | 78.9 Ų | 78.9 | 6% | 0.059 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -118 | 14.9 | -176.5 | -58.2 | -74.3 | 0 | 0 | 0 | 113.1 | L7 F30 I31 S32 Q36 C37 L38 V55 L56 | L7-Y34 HydrophobicContact CD1-CE2 4.26Å; F30-Y34 HydrophobicContact CD1-CD2 4.44Å; F30-Y34 AromaticContact CD2-CD2 3.6Å; F30-Y34 HydrophobicContact CD2-CD2 3.6Å; F30-Y34 AromaticContact CD2-CE2 3.58Å; F30-Y34 HydrophobicContact CD2-CE2 3.58Å; F30-Y34 HydrophobicContact CE1-CD2 4.42Å; F30-Y34 AromaticContact CE2-CD2 3.57Å; F30-Y34 HydrophobicContact CE2-CD2 3.57Å; F30-Y34 AromaticContact CE2-CE2 3.58Å; F30-Y34 HydrophobicContact CE2-CE2 3.58Å; F30-Y34 HydrophobicContact CG-CD2 4.04Å; F30-Y34 HydrophobicContact CG-CE2 4.4Å; F30-Y34 HydrophobicContact CZ-CD2 4.01Å; F30-Y34 HydrophobicContact CZ-CE2 4.42Å; F30-Y34 WeakPolarHBondContact O-CD2 3.41Å; F30-Y34 PolarHBondContact O-N 3.14Å; I31-Y34 CarbonylContact O-C 3.52Å; I31-Y34 PolarHBondContact O-N 2.93Å; S32-Y34 VanDerWaalsContact C-N 3.3Å; S32-Y34 PolarHBondContact O-N 3.31Å; Y34-Q36 PolarHBondContact O-N 2.74Å; Y34-C37 CarbonylContact O-C 3.53Å; Y34-C37 PolarHBondContact O-N 3.32Å; Y34-L38 VanDerWaalsContact CB-CG 3.49Å; Y34-L38 WeakPolarHBondContact O-CB 3.41Å; Y34-L38 VanDerWaalsContact O-CG 3.3Å; Y34-L38 WeakPolarHBondContact O-CG 3.47Å; Y34-L38 PolarHBondContact O-N 2.89Å; Y34-V55 PolarHBondContact OH-O 2.98Å; Y34-L56 HydrophobicContact CD1-CD1 4.26Å; Y34-L56 HydrophobicContact CD1-CD2 3.88Å; Y34-L56 HydrophobicContact CD1-CG 3.85Å; Y34-L56 HydrophobicContact CD2-CD2 4.07Å; Y34-L56 HydrophobicContact CE1-CD1 4.38Å; Y34-L56 HydrophobicContact CE1-CD2 3.52Å; Y34-L56 HydrophobicContact CE1-CG 3.49Å; Y34-L56 VanDerWaalsContact CE1-CG 3.49Å; Y34-L56 HydrophobicContact CE2-CD2 3.76Å; Y34-L56 HydrophobicContact CG-CD2 4.15Å; Y34-L56 VanDerWaalsContact CZ-CD2 3.46Å |
| 35 | E | 69.4 | Low | 71.1 | Confident | 130 Ų | 130 | 77.9 Ų | 77.9 | 61% | 0.607 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.6 | -31.2 | -176 | 65.5 | 179.7 | 104.4 | 0 | 0 | 113.4 | I31 | I31-E35 VanDerWaalsContact O-CA 3.24Å; I31-E35 WeakPolarHBondContact O-CA 3.47Å; I31-E35 WeakPolarHBondContact O-CB 3.3Å; I31-E35 PolarHBondContact O-N 3.23Å |
| 36 | Q | 64 | Low | 69.5 | Low | 189 Ų | 189 | 81 Ų | 81 | 88% | 0.883 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.9 | -17.8 | -179.6 | -53.7 | -167.3 | -78.3 | 0 | 0 | 113.1 | Y34 | Y34-Q36 PolarHBondContact O-N 2.74Š|
| 37 | C | 63.3 | Low | 67.8 | Low | 82 Ų | 82 | 85.5 Ų | 85.5 | 55% | 0.554 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.1 | -21.4 | -176.8 | -57.7 | 0 | 0 | 0 | 0 | 112.9 | Y34 | Y34-C37 CarbonylContact O-C 3.53Å; Y34-C37 PolarHBondContact O-N 3.32Å |
| 38 | L | 64.9 | Low | 66.4 | Low | 25 Ų | 25 | 94.4 Ų | 94.4 | 13% | 0.131 | 49% | 0.494 | C | S | . | . | trans | -86.2 | 116.8 | 179.8 | -67.2 | -179.6 | 0 | 0 | 0 | 110 | F30 Y34 V40 L64 | F30-L38 HydrophobicContact CD1-CD1 3.83Å; F30-L38 HydrophobicContact CE1-CD1 3.45Å; F30-L38 VanDerWaalsContact CE1-CD1 3.45Å; F30-L38 HydrophobicContact CE1-CD2 4.09Å; F30-L38 HydrophobicContact CE1-CG 4.36Å; F30-L38 HydrophobicContact CZ-CD1 4.28Å; F30-L38 HydrophobicContact CZ-CD2 4.29Å; Y34-L38 VanDerWaalsContact CB-CG 3.49Å; Y34-L38 WeakPolarHBondContact O-CB 3.41Å; Y34-L38 VanDerWaalsContact O-CG 3.3Å; Y34-L38 WeakPolarHBondContact O-CG 3.47Å; Y34-L38 PolarHBondContact O-N 2.89Å; L38-V40 VanDerWaalsContact C-N 3.29Å; L38-V40 HydrophobicContact CB-CG2 4.11Å; L38-V40 PolarHBondContact O-N 3.03Å; L38-V40 VanDerWaalsContact O-N 3.08Å; L38-L64 HydrophobicContact CD1-CD1 4.21Å; L38-L64 HydrophobicContact CD2-CD1 3.4Å; L38-L64 HydrophobicContact CG-CD1 4.27Å | ||
| 39 | D | 66.6 | Low | 64.8 | Low | 55 Ų | 55 | 94.6 Ų | 94.6 | 29% | 0.294 | 51% | 0.505 | S | S | . | . | trans | -79.2 | 84 | 162.7 | -176.6 | 15.5 | 0 | 0 | 0 | 109.1 | D41 F42 E43 K44 | D39-D41 PolarHBondContact O-N 3.17Å; D39-F42 VanDerWaalsContact CG-CA 3.48Å; D39-F42 PolarHBondContact O-N 3.45Å; D39-F42 PolarHBondContact OD1-N 2.93Å; D39-F42 VanDerWaalsContact OD1-N 3.09Å; D39-F42 WeakPolarHBondContact OD2-CA 3.45Å; D39-E43 PolarHBondContact OD1-N 3.35Å; D39-E43 PolarHBondContact OD2-N 2.9Å; D39-K44 WeakPolarHBondContact OD2-CA 3.3Å; D39-K44 VanDerWaalsContact OD2-CB 3.3Å; D39-K44 WeakPolarHBondContact OD2-CB 3.49Å; D39-K44 PolarHBondContact OD2-N 3.47Å | ||
| 40 | V | 61 | Low | 63.2 | Low | 81 Ų | 81 | 100.6 Ų | 100.6 | 49% | 0.491 | 54% | 0.537 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.6 | -33 | -177.7 | -175.3 | 0 | 0 | 0 | 0 | 111.3 | L38 F42 | L38-V40 VanDerWaalsContact C-N 3.29Å; L38-V40 HydrophobicContact CB-CG2 4.11Å; L38-V40 PolarHBondContact O-N 3.03Å; L38-V40 VanDerWaalsContact O-N 3.08Å; V40-F42 VanDerWaalsContact C-N 3.33Å; V40-F42 WeakPolarHBondContact O-CD2 3.46Å |
| 41 | D | 62.6 | Low | 61.6 | Low | 121 Ų | 121 | 109.2 Ų | 109.2 | 65% | 0.647 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -6.7 | -179.6 | -60.9 | -63.4 | 0 | 0 | 0 | 112.5 | D39 E43 | D39-D41 PolarHBondContact O-N 3.17Å; D41-E43 HydrophobicContact CB-CB 4.5Å; D41-E43 HydrophobicContact CB-CG 3.82Å; D41-E43 PolarHBondContact O-N 2.83Å; D41-E43 VanDerWaalsContact O-N 3.14Å |
| 42 | F | 62.5 | Low | 60.4 | Low | 88 Ų | 88 | 111.1 Ų | 111.1 | 39% | 0.386 | 59% | 0.592 | S | S | . | * | trans | 51.6 | 28.6 | -176 | -59.5 | -94.8 | 0 | 0 | 0 | 112.7 | D39 V40 | D39-F42 VanDerWaalsContact CG-CA 3.48Å; D39-F42 PolarHBondContact O-N 3.45Å; D39-F42 PolarHBondContact OD1-N 2.93Å; D39-F42 VanDerWaalsContact OD1-N 3.09Å; D39-F42 WeakPolarHBondContact OD2-CA 3.45Å; V40-F42 VanDerWaalsContact C-N 3.33Å; V40-F42 WeakPolarHBondContact O-CD2 3.46Å | ||
| 43 | E | 59.8 | Low | 59.1 | Low | 165 Ų | 165 | 109.7 Ų | 109.7 | 77% | 0.771 | 58% | 0.581 | S | S | * | * | trans | -84.1 | -21.8 | -176.1 | -72.7 | -168.4 | 103.3 | 0 | 0 | 112.5 | D39 D41 | D39-E43 PolarHBondContact OD1-N 3.35Å; D39-E43 PolarHBondContact OD2-N 2.9Å; D41-E43 HydrophobicContact CB-CB 4.5Å; D41-E43 HydrophobicContact CB-CG 3.82Å; D41-E43 PolarHBondContact O-N 2.83Å; D41-E43 VanDerWaalsContact O-N 3.14Å | ||
| 44 | K | 57.6 | Low | 57.9 | Low | 151 Ų | 151 | 112.3 Ų | 112.3 | 66% | 0.657 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -89.7 | 133.2 | 177.5 | -110 | 173.8 | 179.1 | 175.7 | 0 | 110.1 | D39 | D39-K44 WeakPolarHBondContact OD2-CA 3.3Å; D39-K44 VanDerWaalsContact OD2-CB 3.3Å; D39-K44 WeakPolarHBondContact OD2-CB 3.49Å; D39-K44 PolarHBondContact OD2-N 3.47Å |
| 45 | P | 55.3 | Low | 57 | Low | 101 Ų | 101 | 114.4 Ų | 114.4 | 66% | 0.656 | 61% | 0.611 | S | S | * | * | trans | -57.7 | 145.2 | 167 | 24.9 | -31.6 | 0 | 0 | 0 | 109 | S47 | P45-S47 PolarHBondContact O-N 3.37Š| ||
| 46 | P | 54.4 | Low | 56.2 | Low | 132 Ų | 132 | 110.4 Ų | 110.4 | 86% | 0.857 | 59% | 0.594 | S | S | * | * | trans | -54.2 | 107.5 | -175.1 | 19.7 | -30.7 | 0 | 0 | 0 | 109.5 | R48 | P46-R48 PolarHBondContact O-N 3.22Š| ||
| 47 | S | 50.7 | Low | 55.7 | Low | 95 Ų | 95 | 107 Ų | 107 | 66% | 0.664 | 59% | 0.586 | S | S | * | * | trans | -58 | 135.6 | 179 | -41.3 | 0 | 0 | 0 | 0 | 108.1 | P45 | P45-S47 PolarHBondContact O-N 3.37Š| ||
| 48 | R | 52.3 | Low | 55.4 | Low | 222 Ų | 222 | 110.1 Ų | 110.1 | 84% | 0.838 | 60% | 0.596 | S | S | * | * | trans | -52.5 | 139.3 | 177.9 | -74.9 | -178.6 | 172.9 | -176.8 | -2.3 | 110 | P46 D50 | P46-R48 PolarHBondContact O-N 3.22Å; R48-D50 PolarHBondContact O-N 2.84Å | ||
| 49 | P | 51.1 | Low | 55.2 | Low | 117 Ų | 117 | 110.5 Ų | 110.5 | 76% | 0.76 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | 24.5 | -168.8 | 30 | -37.1 | 0 | 0 | 0 | 115.3 | E51 | P49-E51 VanDerWaalsContact C-N 3.33Å; P49-E51 PolarHBondContact O-N 3.44Å |
| 50 | D | 49.4 | Very low | 55 | Low | 151 Ų | 151 | 111.3 Ų | 111.3 | 81% | 0.807 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | -19 | -171.6 | -122.4 | -88.9 | 0 | 0 | 0 | 113.5 | R48 | R48-D50 PolarHBondContact O-N 2.84Š|
| 51 | E | 48 | Very low | 55.1 | Low | 182 Ų | 182 | 116 Ų | 116 | 85% | 0.85 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -98.8 | 89.8 | 163.2 | -82.8 | 178.9 | 86.8 | 0 | 0 | 108.1 | P49 P53 | P49-E51 VanDerWaalsContact C-N 3.33Å; P49-E51 PolarHBondContact O-N 3.44Å; E51-P53 WeakPolarHBondContact O-CD 3.26Å |
| 52 | V | 50.8 | Low | 55.3 | Low | 110 Ų | 110 | 114 Ų | 114 | 67% | 0.667 | 62% | 0.618 | S | S | * | * | trans | -50.4 | 113 | 167.6 | 178.4 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 53 | P | 50.7 | Low | 55.9 | Low | 44 Ų | 44 | 110.9 Ų | 110.9 | 29% | 0.286 | 61% | 0.605 | S | S | . | * | trans | -63.6 | 130.2 | -177.8 | -13.9 | 25.7 | 0 | 0 | 0 | 107.1 | E51 V55 L56 | E51-P53 WeakPolarHBondContact O-CD 3.26Å; P53-V55 PolarHBondContact O-N 3.35Å; P53-L56 HydrophobicContact CB-CB 3.94Å; P53-L56 HydrophobicContact CB-CD1 3.55Å; P53-L56 HydrophobicContact CB-CG 3.85Å; P53-L56 HydrophobicContact CG-CB 4.19Å; P53-L56 HydrophobicContact CG-CD1 3.64Å; P53-L56 HydrophobicContact CG-CG 4.31Å | ||
| 54 | P | 50.5 | Low | 56.5 | Low | 103 Ų | 103 | 105.3 Ų | 105.3 | 67% | 0.669 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.2 | 113.1 | 177.2 | 0.7 | 5.6 | 0 | 0 | 0 | 107.5 | ||
| 55 | V | 52.6 | Low | 57 | Low | 59 Ų | 59 | 104.2 Ų | 104.2 | 36% | 0.358 | 58% | 0.578 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 80.8 | 6.5 | 168.5 | -160.5 | 0 | 0 | 0 | 0 | 117.5 | N4 Y34 P53 T57 | N4-V55 HydrophobicContact CB-CG1 4.15Å; N4-V55 VanDerWaalsContact CG-CG1 3.49Å; Y34-V55 PolarHBondContact OH-O 2.98Å; P53-V55 PolarHBondContact O-N 3.35Å; V55-T57 PolarHBondContact O-N 3.48Å; V55-T57 VanDerWaalsContact O-N 3.17Å |
| 56 | L | 52.3 | Low | 58 | Low | 46 Ų | 46 | 102.7 Ų | 102.7 | 24% | 0.241 | 57% | 0.566 | C | S | . | * | G | 310 helix | trans | -68.6 | -9.4 | 169.2 | -82.1 | 179.4 | 0 | 0 | 0 | 113.9 | F30 Y34 P53 L58 L59 | F30-L56 HydrophobicContact CE2-CD2 3.88Å; F30-L56 HydrophobicContact CZ-CD2 4.12Å; Y34-L56 HydrophobicContact CD1-CD1 4.26Å; Y34-L56 HydrophobicContact CD1-CD2 3.88Å; Y34-L56 HydrophobicContact CD1-CG 3.85Å; Y34-L56 HydrophobicContact CD2-CD2 4.07Å; Y34-L56 HydrophobicContact CE1-CD1 4.38Å; Y34-L56 HydrophobicContact CE1-CD2 3.52Å; Y34-L56 HydrophobicContact CE1-CG 3.49Å; Y34-L56 VanDerWaalsContact CE1-CG 3.49Å; Y34-L56 HydrophobicContact CE2-CD2 3.76Å; Y34-L56 HydrophobicContact CG-CD2 4.15Å; Y34-L56 VanDerWaalsContact CZ-CD2 3.46Å; P53-L56 HydrophobicContact CB-CB 3.94Å; P53-L56 HydrophobicContact CB-CD1 3.55Å; P53-L56 HydrophobicContact CB-CG 3.85Å; P53-L56 HydrophobicContact CG-CB 4.19Å; P53-L56 HydrophobicContact CG-CD1 3.64Å; P53-L56 HydrophobicContact CG-CG 4.31Å; L56-L58 PolarHBondContact O-N 3.33Å; L56-L59 PolarHBondContact O-N 3.5Å |
| 57 | T | 52.4 | Low | 59 | Low | 117 Ų | 117 | 96.9 Ų | 96.9 | 72% | 0.718 | 53% | 0.528 | S | S | * | . | G | 310 helix | trans | -63.9 | -6.1 | -175.7 | 51.2 | 0 | 0 | 0 | 0 | 115.7 | V55 | V55-T57 PolarHBondContact O-N 3.48Å; V55-T57 VanDerWaalsContact O-N 3.17Å |
| 58 | L | 57.8 | Low | 60.3 | Low | 148 Ų | 148 | 98.6 Ų | 98.6 | 78% | 0.775 | 52% | 0.52 | S | S | * | . | G | 310 helix | trans | -100 | -14.4 | -179.8 | -64.7 | 174.1 | 0 | 0 | 0 | 113.9 | L56 | L56-L58 PolarHBondContact O-N 3.33Š|
| 59 | L | 60.8 | Low | 61.4 | Low | 33 Ų | 33 | 93.4 Ų | 93.4 | 17% | 0.173 | 51% | 0.505 | C | S | . | . | S | Bend | trans | -111.2 | 145 | 178 | -68.8 | 168.1 | 0 | 0 | 0 | 109.9 | L7 W26 F30 L56 D61 I63 | L7-L59 HydrophobicContact CD2-CD1 3.96Å; W26-L59 HydrophobicContact CH2-CD1 4.2Å; W26-L59 HydrophobicContact CZ2-CD1 3.63Å; W26-L59 HydrophobicContact CZ2-CD2 3.96Å; W26-L59 HydrophobicContact CZ2-CG 4.47Å; F30-L59 HydrophobicContact CD2-CD1 3.83Å; F30-L59 HydrophobicContact CE2-CD1 3.59Å; L56-L59 PolarHBondContact O-N 3.5Å; L59-D61 PolarHBondContact O-N 2.74Å; L59-I63 HydrophobicContact CB-CG2 4.43Å |
| 60 | P | 61.9 | Low | 62.5 | Low | 72 Ų | 72 | 92.8 Ų | 92.8 | 47% | 0.468 | 49% | 0.492 | S | S | . | . | trans | -56.6 | 135.4 | 176.1 | -22.7 | 32.7 | 0 | 0 | 0 | 111.1 | N62 I63 | P60-N62 VanDerWaalsContact CB-OD1 3.24Å; P60-N62 WeakPolarHBondContact CB-OD1 3.21Å; P60-N62 PolarHBondContact O-N 3.04Å; P60-I63 WeakPolarHBondContact O-CB 3.46Å; P60-I63 WeakPolarHBondContact O-CG2 3.34Å; P60-I63 PolarHBondContact O-N 3.22Å | ||
| 61 | D | 64.3 | Low | 63.9 | Low | 178 Ų | 178 | 90.1 Ų | 90.1 | 95% | 0.952 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.8 | -24.7 | -178.8 | -59.8 | -91.5 | 0 | 0 | 0 | 113.4 | L59 | L59-D61 PolarHBondContact O-N 2.74Š|
| 62 | N | 66.2 | Low | 65.3 | Low | 79 Ų | 79 | 86.1 Ų | 86.1 | 42% | 0.422 | 46% | 0.461 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.9 | 7.6 | -177.5 | 64.7 | -8 | 0 | 0 | 0 | 114 | P60 L64 Q65 V66 | P60-N62 VanDerWaalsContact CB-OD1 3.24Å; P60-N62 WeakPolarHBondContact CB-OD1 3.21Å; P60-N62 PolarHBondContact O-N 3.04Å; N62-L64 VanDerWaalsContact C-N 3.26Å; N62-L64 PolarHBondContact O-N 3.09Å; N62-Q65 WeakPolarHBondContact O-CA 3.3Å; N62-Q65 WeakPolarHBondContact O-CB 3.37Å; N62-Q65 PolarHBondContact O-N 3.2Å; N62-V66 WeakPolarHBondContact O-CG2 3.25Å; N62-V66 PolarHBondContact O-N 3.08Å |
| 63 | I | 74.2 | Confident | 66.5 | Low | 24 Ų | 24 | 84.9 Ų | 84.9 | 12% | 0.123 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -55.9 | -41.9 | -174.2 | -168.9 | 60.9 | 0 | 0 | 0 | 111.8 | W26 F30 L59 P60 Q65 V66 L67 | W26-I63 HydrophobicContact CH2-CG1 4.14Å; F30-I63 HydrophobicContact CZ-CG2 4.36Å; L59-I63 HydrophobicContact CB-CG2 4.43Å; P60-I63 WeakPolarHBondContact O-CB 3.46Å; P60-I63 WeakPolarHBondContact O-CG2 3.34Å; P60-I63 PolarHBondContact O-N 3.22Å; I63-Q65 PolarHBondContact O-N 3.4Å; I63-V66 PolarHBondContact O-N 2.94Å; I63-L67 HydrophobicContact CD1-CG 4.38Å; I63-L67 HydrophobicContact CG1-CD1 4.04Å; I63-L67 HydrophobicContact CG1-CG 4.33Å; I63-L67 WeakPolarHBondContact O-CB 3.45Å; I63-L67 WeakPolarHBondContact O-CG 3.23Å; I63-L67 PolarHBondContact O-N 3.44Å |
| 64 | L | 72.5 | Confident | 67.8 | Low | 47 Ų | 47 | 85.9 Ų | 85.9 | 25% | 0.246 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -64.5 | -38 | 176.4 | -76.1 | -178.5 | 0 | 0 | 0 | 113.3 | F30 L38 N62 R68 | F30-L64 HydrophobicContact CD1-CD2 4.2Å; F30-L64 HydrophobicContact CE1-CD1 3.99Å; F30-L64 HydrophobicContact CE1-CD2 3.61Å; F30-L64 HydrophobicContact CE1-CG 3.8Å; F30-L64 HydrophobicContact CZ-CD2 4.5Å; F30-L64 HydrophobicContact CZ-CG 4.3Å; L38-L64 HydrophobicContact CD1-CD1 4.21Å; L38-L64 HydrophobicContact CD2-CD1 3.4Å; L38-L64 HydrophobicContact CG-CD1 4.27Å; N62-L64 VanDerWaalsContact C-N 3.26Å; N62-L64 PolarHBondContact O-N 3.09Å; L64-R68 VanDerWaalsContact O-CB 3.29Å; L64-R68 WeakPolarHBondContact O-CB 3.18Å; L64-R68 PolarHBondContact O-N 3.5Å |
| 65 | Q | 68.3 | Low | 69 | Low | 129 Ų | 129 | 85.4 Ų | 85.4 | 60% | 0.603 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -66.1 | -43.5 | 175.9 | -69.1 | -178.2 | -9.5 | 0 | 0 | 111.1 | N62 I63 R68 H69 | N62-Q65 WeakPolarHBondContact O-CA 3.3Å; N62-Q65 WeakPolarHBondContact O-CB 3.37Å; N62-Q65 PolarHBondContact O-N 3.2Å; I63-Q65 PolarHBondContact O-N 3.4Å; Q65-R68 PolarHBondContact O-N 2.97Å; Q65-H69 WeakPolarHBondContact O-CB 3.17Å; Q65-H69 PolarHBondContact O-N 3.43Å |
| 66 | V | 76.8 | Confident | 69.9 | Low | 68 Ų | 68 | 89 Ų | 89 | 41% | 0.412 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.8 | -47 | 176.6 | 174.5 | 0 | 0 | 0 | 0 | 110.4 | N62 I63 H69 Q70 | N62-V66 WeakPolarHBondContact O-CG2 3.25Å; N62-V66 PolarHBondContact O-N 3.08Å; I63-V66 PolarHBondContact O-N 2.94Å; V66-H69 PolarHBondContact O-N 2.91Å; V66-Q70 WeakPolarHBondContact O-CB 3.41Å; V66-Q70 PolarHBondContact O-N 2.76Å |
| 67 | L | 76.3 | Confident | 70.5 | Confident | 11 Ų | 11 | 91.8 Ų | 91.8 | 6% | 0.058 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -64.4 | -42.8 | 179.7 | -69.1 | 178 | 0 | 0 | 0 | 112.3 | F23 W26 L27 I63 H69 Q70 L71 | F23-L67 HydrophobicContact CE1-CD2 4.24Å; F23-L67 HydrophobicContact CE2-CD1 4.07Å; F23-L67 HydrophobicContact CE2-CD2 3.68Å; F23-L67 HydrophobicContact CE2-CG 4.49Å; F23-L67 HydrophobicContact CZ-CD1 3.74Å; F23-L67 HydrophobicContact CZ-CD2 3.22Å; F23-L67 HydrophobicContact CZ-CG 4Å; W26-L67 HydrophobicContact CH2-CD1 4.38Å; W26-L67 HydrophobicContact CZ3-CD1 3.76Å; L27-L67 HydrophobicContact CD2-CD1 3.96Å; I63-L67 HydrophobicContact CD1-CG 4.38Å; I63-L67 HydrophobicContact CG1-CD1 4.04Å; I63-L67 HydrophobicContact CG1-CG 4.33Å; I63-L67 WeakPolarHBondContact O-CB 3.45Å; I63-L67 WeakPolarHBondContact O-CG 3.23Å; I63-L67 PolarHBondContact O-N 3.44Å; L67-H69 VanDerWaalsContact C-N 3.34Å; L67-H69 PolarHBondContact O-N 3.42Å; L67-Q70 PolarHBondContact O-N 3.01Å; L67-L71 WeakPolarHBondContact O-CB 3.03Å; L67-L71 VanDerWaalsContact O-CG 3.28Å; L67-L71 WeakPolarHBondContact O-CG 3.3Å; L67-L71 PolarHBondContact O-N 3.17Å |
| 68 | R | 76.5 | Confident | 71.1 | Confident | 130 Ų | 130 | 92 Ų | 92 | 49% | 0.491 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -58.3 | -47.5 | 173.5 | -179.2 | -179 | 179.4 | 173.5 | 1.4 | 111.1 | L64 Q65 L71 L72 | L64-R68 VanDerWaalsContact O-CB 3.29Å; L64-R68 WeakPolarHBondContact O-CB 3.18Å; L64-R68 PolarHBondContact O-N 3.5Å; Q65-R68 PolarHBondContact O-N 2.97Å; R68-L71 PolarHBondContact O-N 3.28Å; R68-L72 HydrophobicContact CG-CD1 4.1Å; R68-L72 WeakPolarHBondContact O-CB 3.42Å; R68-L72 VanDerWaalsContact O-CG 3.3Å; R68-L72 WeakPolarHBondContact O-CG 3.25Å; R68-L72 PolarHBondContact O-N 3.23Å |
| 69 | H | 75.1 | Confident | 71.5 | Confident | 114 Ų | 114 | 89.7 Ų | 89.7 | 53% | 0.528 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.7 | -43.8 | 179.3 | -164.8 | 81.7 | 0 | 0 | 0 | 111.3 | Q65 V66 L67 L71 L72 Q73 | Q65-H69 WeakPolarHBondContact O-CB 3.17Å; Q65-H69 PolarHBondContact O-N 3.43Å; V66-H69 PolarHBondContact O-N 2.91Å; L67-H69 VanDerWaalsContact C-N 3.34Å; L67-H69 PolarHBondContact O-N 3.42Å; H69-L71 PolarHBondContact O-N 3.26Å; H69-L72 PolarHBondContact O-N 2.8Å; H69-Q73 PolarHBondContact NE2-NE2 2.82Å; H69-Q73 VanDerWaalsContact NE2-NE2 3.12Å; H69-Q73 WeakPolarHBondContact O-CB 3.47Å; H69-Q73 WeakPolarHBondContact O-CG 3.21Å; H69-Q73 PolarHBondContact O-N 3.05Å |
| 70 | Q | 75.4 | Confident | 71.4 | Confident | 104 Ų | 104 | 93.7 Ų | 93.7 | 49% | 0.486 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.1 | -40.2 | 179.6 | -164 | 173.8 | 19.8 | 0 | 0 | 112.1 | V66 L67 Q73 C74 | V66-Q70 WeakPolarHBondContact O-CB 3.41Å; V66-Q70 PolarHBondContact O-N 2.76Å; L67-Q70 PolarHBondContact O-N 3.01Å; Q70-Q73 PolarHBondContact O-N 2.85Å; Q70-C74 WeakPolarHBondContact O-CB 3.25Å; Q70-C74 PolarHBondContact O-N 2.84Å; Q70-C74 PolarHBondContact O-SG 3.44Å |
| 71 | L | 78.9 | Confident | 71.2 | Confident | 95 Ų | 95 | 93.7 Ų | 93.7 | 50% | 0.497 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.9 | -44 | 174.1 | -74.1 | 168.7 | 0 | 0 | 0 | 111.8 | L67 R68 H69 Q73 C74 V75 | L67-L71 WeakPolarHBondContact O-CB 3.03Å; L67-L71 VanDerWaalsContact O-CG 3.28Å; L67-L71 WeakPolarHBondContact O-CG 3.3Å; L67-L71 PolarHBondContact O-N 3.17Å; R68-L71 PolarHBondContact O-N 3.28Å; H69-L71 PolarHBondContact O-N 3.26Å; L71-Q73 VanDerWaalsContact C-N 3.33Å; L71-Q73 PolarHBondContact O-N 3.03Å; L71-C74 PolarHBondContact O-N 3.12Å; L71-V75 WeakPolarHBondContact O-CG2 3.27Å; L71-V75 PolarHBondContact O-N 3.4Å |
| 72 | L | 77.2 | Confident | 70.4 | Confident | 98 Ų | 98 | 91 Ų | 91 | 51% | 0.513 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.4 | -44.3 | 174.9 | -75.4 | 170.4 | 0 | 0 | 0 | 111.3 | R68 H69 C74 V75 Q76 | R68-L72 HydrophobicContact CG-CD1 4.1Å; R68-L72 WeakPolarHBondContact O-CB 3.42Å; R68-L72 VanDerWaalsContact O-CG 3.3Å; R68-L72 WeakPolarHBondContact O-CG 3.25Å; R68-L72 PolarHBondContact O-N 3.23Å; H69-L72 PolarHBondContact O-N 2.8Å; L72-C74 PolarHBondContact O-N 2.88Å; L72-V75 PolarHBondContact O-N 3.27Å; L72-Q76 WeakPolarHBondContact O-CB 3.24Å; L72-Q76 PolarHBondContact O-N 3.42Å |
| 73 | Q | 75.1 | Confident | 69.8 | Low | 83 Ų | 83 | 93.8 Ų | 93.8 | 39% | 0.388 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.5 | -42.4 | 174.9 | -71.1 | -72.5 | -6.8 | 0 | 0 | 111.8 | H69 Q70 L71 Q76 K77 | H69-Q73 PolarHBondContact NE2-NE2 2.82Å; H69-Q73 VanDerWaalsContact NE2-NE2 3.12Å; H69-Q73 WeakPolarHBondContact O-CB 3.47Å; H69-Q73 WeakPolarHBondContact O-CG 3.21Å; H69-Q73 PolarHBondContact O-N 3.05Å; Q70-Q73 PolarHBondContact O-N 2.85Å; L71-Q73 VanDerWaalsContact C-N 3.33Å; L71-Q73 PolarHBondContact O-N 3.03Å; Q73-Q76 PolarHBondContact O-N 3.28Å; Q73-K77 WeakPolarHBondContact O-CB 3.33Å; Q73-K77 VanDerWaalsContact O-CG 3.27Å; Q73-K77 WeakPolarHBondContact O-CG 3.38Å; Q73-K77 PolarHBondContact O-N 3.02Å |
| 74 | C | 77.9 | Confident | 68.7 | Low | 66 Ų | 66 | 98.2 Ų | 98.2 | 45% | 0.446 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.2 | -46.7 | 174.6 | -74.4 | 0 | 0 | 0 | 0 | 111.8 | Q70 L71 L72 Q76 K77 V78 | Q70-C74 WeakPolarHBondContact O-CB 3.25Å; Q70-C74 PolarHBondContact O-N 2.84Å; Q70-C74 PolarHBondContact O-SG 3.44Å; L71-C74 PolarHBondContact O-N 3.12Å; L72-C74 PolarHBondContact O-N 2.88Å; C74-Q76 VanDerWaalsContact C-N 3.29Å; C74-Q76 PolarHBondContact O-N 3.5Å; C74-K77 PolarHBondContact O-N 3.38Å; C74-V78 WeakPolarHBondContact O-CB 3.47Å; C74-V78 WeakPolarHBondContact O-CG2 3.34Å; C74-V78 PolarHBondContact O-N 2.81Å |
| 75 | V | 76.4 | Confident | 67.3 | Low | 92 Ų | 92 | 102.6 Ų | 102.6 | 56% | 0.558 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -63 | -38.1 | 177.5 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | L71 L72 S79 | L71-V75 WeakPolarHBondContact O-CG2 3.27Å; L71-V75 PolarHBondContact O-N 3.4Å; L72-V75 PolarHBondContact O-N 3.27Å; V75-S79 WeakPolarHBondContact O-CB 3.31Å; V75-S79 PolarHBondContact O-N 3.46Å; V75-S79 PolarHBondContact O-OG 3.28Å |
| 76 | Q | 70.6 | Confident | 66.8 | Low | 135 Ų | 135 | 105.7 Ų | 105.7 | 63% | 0.631 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.5 | -47.7 | 176.7 | -159.4 | 105.9 | 51.9 | 0 | 0 | 111.3 | L72 Q73 C74 V78 S79 D80 | L72-Q76 WeakPolarHBondContact O-CB 3.24Å; L72-Q76 PolarHBondContact O-N 3.42Å; Q73-Q76 PolarHBondContact O-N 3.28Å; C74-Q76 VanDerWaalsContact C-N 3.29Å; C74-Q76 PolarHBondContact O-N 3.5Å; Q76-V78 VanDerWaalsContact C-N 3.35Å; Q76-V78 PolarHBondContact O-N 2.88Å; Q76-S79 PolarHBondContact O-N 3.01Å; Q76-D80 WeakPolarHBondContact O-CB 3.41Å; Q76-D80 PolarHBondContact O-N 3.38Å |
| 77 | K | 66.3 | Low | 65.1 | Low | 105 Ų | 105 | 109.3 Ų | 109.3 | 46% | 0.457 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -60.9 | -41.1 | 176.4 | -74.2 | 179.1 | 177.3 | -166.3 | 0 | 112.7 | Q73 C74 G81 | Q73-K77 WeakPolarHBondContact O-CB 3.33Å; Q73-K77 VanDerWaalsContact O-CG 3.27Å; Q73-K77 WeakPolarHBondContact O-CG 3.38Å; Q73-K77 PolarHBondContact O-N 3.02Å; C74-K77 PolarHBondContact O-N 3.38Å; K77-G81 PolarHBondContact O-N 3.01Å |
| 78 | V | 65.1 | Low | 63.8 | Low | 120 Ų | 120 | 115.8 Ų | 115.8 | 73% | 0.727 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -70.2 | -36 | 177.4 | 175.5 | 0 | 0 | 0 | 0 | 111.5 | C74 Q76 | C74-V78 WeakPolarHBondContact O-CB 3.47Å; C74-V78 WeakPolarHBondContact O-CG2 3.34Å; C74-V78 PolarHBondContact O-N 2.81Å; Q76-V78 VanDerWaalsContact C-N 3.35Å; Q76-V78 PolarHBondContact O-N 2.88Å |
| 79 | S | 64.9 | Low | 62.1 | Low | 101 Ų | 101 | 117.3 Ų | 117.3 | 71% | 0.706 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -73.2 | -32.5 | 176.3 | -77.3 | 0 | 0 | 0 | 0 | 113.9 | V75 Q76 G81 | V75-S79 WeakPolarHBondContact O-CB 3.31Å; V75-S79 PolarHBondContact O-N 3.46Å; V75-S79 PolarHBondContact O-OG 3.28Å; Q76-S79 PolarHBondContact O-N 3.01Å; S79-G81 VanDerWaalsContact C-N 3.26Å; S79-G81 PolarHBondContact O-N 2.82Å |
| 80 | D | 60 | Low | 60.3 | Low | 116 Ų | 116 | 119.5 Ų | 119.5 | 62% | 0.62 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -78.9 | -10 | -178.6 | -155.3 | -113.1 | 0 | 0 | 0 | 112.7 | Q76 L82 | Q76-D80 WeakPolarHBondContact O-CB 3.41Å; Q76-D80 PolarHBondContact O-N 3.38Å; D80-L82 HydrophobicContact CB-CB 4.48Å; D80-L82 PolarHBondContact O-N 2.86Å |
| 81 | G | 56.6 | Low | 59.6 | Low | 72 Ų | 72 | 120.3 Ų | 120.3 | 74% | 0.742 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 63.3 | 23.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | K77 S79 | K77-G81 PolarHBondContact O-N 3.01Å; S79-G81 VanDerWaalsContact C-N 3.26Å; S79-G81 PolarHBondContact O-N 2.82Å |
| 82 | L | 47.6 | Very low | 58.5 | Low | 122 Ų | 122 | 121.6 Ų | 121.6 | 64% | 0.639 | 69% | 0.685 | S | S | * | * | trans | -121.7 | 85.1 | -172.2 | -147.9 | 98.4 | 0 | 0 | 0 | 110.5 | D80 | D80-L82 HydrophobicContact CB-CB 4.48Å; D80-L82 PolarHBondContact O-N 2.86Å | ||
| 83 | E | 53.2 | Low | 57.5 | Low | 137 Ų | 137 | 122.9 Ų | 122.9 | 64% | 0.64 | 70% | 0.695 | S | S | * | * | trans | -97.2 | 139.8 | 149.1 | -70 | -70.7 | 116.6 | 0 | 0 | 106.1 | ||||
| 84 | P | 51.2 | Low | 56.5 | Low | 118 Ų | 118 | 125.3 Ų | 125.3 | 77% | 0.766 | 71% | 0.713 | S | S | * | * | cis | -137.3 | 158.9 | 39.9 | 37.9 | -20.2 | 0 | 0 | 0 | 114.5 | ||||
| 85 | E | 44 | Very low | 55.1 | Low | 138 Ų | 138 | 129 Ų | 129 | 65% | 0.645 | 73% | 0.73 | S | S | * | * | -161.5 | 117.2 | 118.8 | -157.5 | 160.5 | 81.5 | 0 | 0 | 111.3 | Q87 | E85-Q87 HydrophobicContact CG-CG 4.04Å; E85-Q87 PolarHBondContact O-N 3.47Å; E85-Q87 PolarHBondContact OE1-NE2 3.4Å | |||
| 86 | Q | 56.7 | Low | 53.7 | Low | 194 Ų | 194 | 131.5 Ų | 131.5 | 91% | 0.907 | 74% | 0.741 | S | S | * | * | trans | -56.1 | 100.7 | 155.4 | -69.4 | 170.3 | -105.2 | 0 | 0 | 109.1 | ||||
| 87 | Q | 41.5 | Very low | 52.5 | Low | 144 Ų | 144 | 131.2 Ų | 131.2 | 67% | 0.673 | 75% | 0.749 | S | S | * | * | trans | -108.3 | 88 | 160.6 | -72.1 | -169.6 | -8.3 | 0 | 0 | 109.7 | E85 L89 | E85-Q87 HydrophobicContact CG-CG 4.04Å; E85-Q87 PolarHBondContact O-N 3.47Å; E85-Q87 PolarHBondContact OE1-NE2 3.4Å; Q87-L89 PolarHBondContact O-N 3.27Å | ||
| 88 | N | 50.4 | Low | 51.4 | Low | 147 Ų | 147 | 133.2 Ų | 133.2 | 79% | 0.786 | 77% | 0.771 | S | S | * | * | trans | -7.5 | 119.1 | 136.7 | -143.8 | -42.4 | 0 | 0 | 0 | 113.2 | ||||
| 89 | L | 40.5 | Very low | 50.3 | Low | 163 Ų | 163 | 134.3 Ų | 134.3 | 85% | 0.853 | 78% | 0.775 | S | S | * | * | trans | -135.8 | 116.5 | 149.4 | -103 | 111.2 | 0 | 0 | 0 | 108.9 | Q87 | Q87-L89 PolarHBondContact O-N 3.27Š| ||
| 90 | A | 36.9 | Very low | 49 | Very low | 160 Ų | 160 | 137.4 Ų | 137.4 | 100% | 1.322 | 78% | 0.781 | S | S | * | * | trans | -59.8 | 0 | 166.9 | 0 | 0 | 0 | 0 | 0 | 112.2 |
Retrieved 90 of 90 residues in 73.6 ms
(Link to these results)